RefChem:1066920
TL;DR: RefChem:1066920 (CAS 67465-43-4) is a chemical compound with molecular formula C14H25HgN2O5 and molecular weight 503.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(5,5-diethyl-2,4,6-trioxo-1,3-diazinan-1-yl)-2-propan-2-yloxypropyl]mercury;hydrate
Also Known As: N-(2-Isopropoxy-3-hydroxymercuripropyl)barbital, Hydroxy(3-(5,5-diethyl-2,4,6-trioxo-(1H,3H,5H)pyrimidino)-2-isopropoxypropyl)mercury, Mercury, hydroxy(3-(5,5-diethyl-2,4,6-trioxo-(1H,3H,5H)pyrimidino)-2-isopropoxypropyl)-, Mercury, [3-(5,5-diethyltetrahydro-2,4,6-trioxo-1(2H)-pyrimidinyl)-2-(1-methylethoxy)propyl]hydroxy-, MERCURY, HYDROXY(3-(5,5-DIETHYL-2,4,6-TRIOXO-(1H,3H,5H)PYRIMIDINO)-2-ISOPROPOXYP
| Molecular Formula | C14H25HgN2O5 |
|---|---|
| Molecular Weight | 503.15 g/mol |
| LogP | 0.81 |
| Topological Polar Surface Area | 76.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 503.147 |
| Heavy Atoms | 22 |
| Complexity | 423.0 |
Chemical Identifiers
| CAS Number | 67465-43-4 |
|---|---|
| SMILES | CCC1(C(=O)NC(=O)N(C1=O)CC(C[Hg])OC(C)C)CC.O |
| InChIKey | WLHWUCYISQFHDN-UHFFFAOYSA-N |
Product Overview
RefChem:1066920 (CAS 67465-43-4), with molecular formula C14H25HgN2O5 and molecular weight 503.15 g/mol. IUPAC: [3-(5,5-diethyl-2,4,6-trioxo-1,3-diazinan-1-yl)-2-propan-2-yloxypropyl]mercury;hydrate.
Chemical Property Profile of RefChem:1066920
Property Insights of RefChem:1066920
The XLogP value of 0.81 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1066920. The TPSA of 76.7 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1066920. Following Lipinski's Rule of Five, RefChem:1066920 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:1066920?
The CAS number of RefChem:1066920 is 67465-43-4.
What is the molecular formula of RefChem:1066920?
The molecular formula of RefChem:1066920 is C14H25HgN2O5.
What is the molecular weight of RefChem:1066920?
The molecular weight of RefChem:1066920 is 503.15 g/mol.
Where can I buy RefChem:1066920?
You can request a quote for RefChem:1066920 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1066920?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1066920 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.